N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)propanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)propanamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-3-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-3-(3,4,5-trimethoxyphenyl)propionamide Formula: C21H21BrN2O4S MolecularWeight: 477.37144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrN2O4S/c1-26-17-10-13(11-18(27-2)20(17)28-3)4-9-19(25)24-21-23-16(12-29-21)14-5-7-15(22)8-6-14/h5-8,10-12H,4,9H2,1-3H3,(H,23,24,25)